1-[1-(3-methylthiophen-2-yl)ethyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1-(3-methylthiophen-2-yl)ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(3-methyl-2-thienyl)ethyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(3-methyl-2-thiophenyl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(3-methylthiophen-2-yl)ethyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(3-methyl-2-thienyl)ethyl]isonipecotic acid Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(C)N2CCC(CC2)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C(C)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C13H19NO2S/c1-9-5-8-17-12(9)10(2)14-6-3-11(4-7-14)13(15)16/h5,8,10-11H,3-4,6-7H2,1-2H3,(H,15,16)